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2-METHYL-4H-3,1-BENZOXATHIIN-2-CARBOXYLIC-ACID,METHYLESTER
SpectraBase Compound ID 1kJoxqyj3vD
InChI InChI=1S/C11H12O3S/c1-11(10(12)13-2)14-7-8-5-3-4-6-9(8)15-11/h3-6H,7H2,1-2H3
InChIKey LZXWIPZLMVGJQU-UHFFFAOYSA-N
Mol Weight 224.27 g/mol
Molecular Formula C11H12O3S
Exact Mass 224.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWjUky7mpWq
Name Methyl 2-methyl-4H-3,1-benzoxathiine-2-carboxylate
CAS Registry Number 124921-58-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3S
InChI InChI=1S/C11H12O3S/c1-11(10(12)13-2)14-7-8-5-3-4-6-9(8)15-11/h3-6H,7H2,1-2H3
InChIKey LZXWIPZLMVGJQU-UHFFFAOYSA-N
Molecular Weight 224.274 g/mol
SMILES C1(Sc2ccccc2CO1)(C(=O)OC)C
SPLASH splash10-00di-0900000000-93eb6b2e4648a11d0722
Source of Spectrum K-123-1146-4
Synonyms Methyl 2-methyl-4H-3,1-benzoxathiin-2-carboxylate
Wiley ID 1224681